1-(6-fluoranyl-1-benzothiophen-3-yl)-1,4-diazepane

Systemtic Name: 1-(6-fluoranyl-1-benzothiophen-3-yl)-1,4-diazepane Openeye Name: 1-(6-fluorobenzothiophen-3-yl)-1,4-diazepane CAS Name: 1-(6-fluoro-1-benzothiophen-3-yl)-1,4-diazepane IUPAC Name: 1-(6-fluoro-1-benzothiophen-3-yl)-1,4-diazepane Traditional Name: 1-(6-fluorobenzothiophen-3-yl)-1,4-diazepane Formula: C13H15FN2S MolecularWeight: 250.335003

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CSC3=C2C=CC(=C3)F

Isomeric SMILES

C1CNCCN(C1)C2=CSC3=C2C=CC(=C3)F

InChI

InChI=1S/C13H15FN2S/c14-10-2-3-11-12(9-17-13(11)8-10)16-6-1-4-15-5-7-16/h2-3,8-9,15H,1,4-7H2